3-[4-[(Z)-N-oxidanidyl-C-(4-propylphenyl)carbonimidoyl]phenyl]-4-phenyl-2H-1,2,3-oxadiazol-3-ium-5-one

Systemtic Name: 3-[4-[(Z)-N-oxidanidyl-C-(4-propylphenyl)carbonimidoyl]phenyl]-4-phenyl-2H-1,2,3-oxadiazol-3-ium-5-one Openeye Name: 3-[4-[(Z)-N-oxido-C-(4-propylphenyl)carbonimidoyl]phenyl]-4-phenyl-2H-oxadiazol-3-ium-5-one CAS Name: 3-[4-[(Z)-oxidoimino-(4-propylphenyl)methyl]phenyl]-4-phenyl-2H-oxadiazol-3-ium-5-one IUPAC Name: 3-[4-[(Z)-N-oxido-C-(4-propylphenyl)carbonimidoyl]phenyl]-4-phenyl-2H-oxadiazol-3-ium-5-one Traditional Name: 3-[4-[(Z)-N-oxido-C-(4-propylphenyl)carbonimidoyl]phenyl]-4-phenyl-2H-oxadiazol-3-ium-5-one Formula: C24H21N3O3 MolecularWeight: 399.44184

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)C(=N[O-])C2=CC=C(C=C2)[N+]3=C(C(=O)ON3)C4=CC=CC=C4

Isomeric SMILES

CCCC1=CC=C(C=C1)/C(=N/[O-])/C2=CC=C(C=C2)[N+]3=C(C(=O)ON3)C4=CC=CC=C4

InChI

InChI=1S/C24H21N3O3/c1-2-6-17-9-11-18(12-10-17)22(25-29)19-13-15-21(16-14-19)27-23(24(28)30-26-27)20-7-4-3-5-8-20/h3-5,7-16H,2,6H2,1H3,(H-,26,28,29)